| Formula |
C19H17ClFN5S |
| IUPAC Name |
5-[[4-[(6-chlorothieno[2,3-d]pyrimidin-4-yl)amino]-1-piperidyl]methyl]-2-fluoro-benzonitrile |
| Molecular Mass |
401.888 g·mol−1 |
| Heat of Formation |
241.3 ± 16.7 kJ·mol−1 |
| Dipole Moment |
6.26 ± 1.08 D |
| Volume |
449.49 Å 3 |
| Surface Area |
393.82 Å 2 |
| HOMO Energy |
-8.87 ± 0.55 eV |
| LUMO Energy |
-1.09 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 5-[[4-[(6-chloro-4-thieno[3,2-e]pyrimidinyl)amino]-1-piperidinyl]methyl]-2-fluorobenzonitrile
- 5-[[4-[(6-chlorothieno[3,2-e]pyrimidin-4-yl)amino]-1-piperidyl]methyl]-2-fluoro-benzonitrile
- 5-[[4-[(6-chlorothieno[3,2-e]pyrimidin-4-yl)amino]piperidin-1-yl]methyl]-2-fluoro-benzonitrile
- 5-[[4-[(6-chlorothieno[3,2-e]pyrimidin-4-yl)amino]piperidin-1-yl]methyl]-2-fluorobenzonitrile
|
| InChIKey |
IENZFHBNCRQMNP-UHFFFAOYSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
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| DOI |
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| Downloads |
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|
| Elements |
C
F
H
Cl
N
S
|
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